Basic information
- CAS
4201-26-7- Standard SMILES
Cc1cc(Cl)ccc1NC1=NCCN1- InChIKey
WCJNRJDOHCANAL-UHFFFAOYSA-N- Molecular formula
- C10H12ClN3
- Average molar mass
- 209.67 g/mol
- Monoisotopic mass
- 209.0719751
Overview
RN given refers to parent cpd; structure in first source
Names & identifiers
- Preferred name
- 2-(2-Methyl-4-chlorophenylamino)-2-imidazoline
- IUPAC
- N-(4-chloro-2-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine
- English name
- 2-(2-methyl-4-chlorophenylamino)-2-imidazoline
- Molecular formula
- C10H12ClN3
- Molecular weight
- 209.68
Names & synonyms
2-(2-Methyl-4-chlorophenylamino)-2-imidazoline4201-26-7CDMIDTXSID40194816RefChem:84092DTXCID80117307n-(4-chloro-2-methylphenyl)-4,5-dihydro-1h-imidazol-2-amineN-(4-chloro-2-methylphenyl)imidazolidin-2-imineCHEMBL62674SCHEMBL10689485SCHEMBL11762970SCHEMBL29349477
Show more names
NC-72-[(4-Chloro-2-methylphenyl)imino]imidazolidine
EBC-76129EN300-7385101H-Imidazol-2-amine, N-(4-chloro-2-methylphenyl)-4,5-dihydro-
Database identifiers
- CAS
4201-26-7- PubChem CID
- 77870
- DTXSID
DTXSID40194816- ChEMBL
CHEMBL62674- Nikkaji
- J325.934J
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 36.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 229
Experimental & physicochemical properties
LogP1.77
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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